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5-Androstenediol-3-acetate tms
SpectraBase Compound ID IvGXJBtVpFC
InChI InChI=1S/C24H40O3Si/c1-16(25)26-18-11-13-23(2)17(15-18)7-8-19-20-9-10-22(27-28(4,5)6)24(20,3)14-12-21(19)23/h7,18-22H,8-15H2,1-6H3/t18-,19-,20-,21-,22-,23-,24-/m0/s1
InChIKey GZPMQCTWFVYDGP-LQDRYOBXSA-N
Mol Weight 404.7 g/mol
Molecular Formula C24H40O3Si
Exact Mass 404.274672 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L0Yn93n2IoD
Name 5-Androstenediol-3-acetate tms
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.274671680 u
Formula C24H40O3Si
InChI InChI=1S/C24H40O3Si/c1-16(25)26-18-11-13-23(2)17(15-18)7-8-19-20-9-10-22(27-28(4,5)6)24(20,3)14-12-21(19)23/h7,18-22H,8-15H2,1-6H3/t18-,19-,20-,21-,22-,23-,24-/m0/s1
InChIKey GZPMQCTWFVYDGP-LQDRYOBXSA-N
Molecular Weight 404.666 g/mol
SMILES [C@@]12([C@]3([C@@]([C@](CC3)(O[Si](C)(C)C)[H])(CC[C@@]1([C@@]1(C(=CC2)C[C@](CC1)(OC(=O)C)[H])C)[H])C)[H])[H]